N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide

C20H20N2O2 — CID 100741423

IUPACN-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)Nc1cccc(C)c1C
InChIInChI=1S/C20H20N2O2/c1-13-7-8-18-16(11-13)19(23)9-10-22(18)12-20(24)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,24)
InChIKeyQLXUJQDAJSMNMJ-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.57
Rot. Bonds3

About N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide

N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide (PubChem CID 100741423) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
PubChem CID100741423
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)Nc1cccc(C)c1C
InChIInChI=1S/C20H20N2O2/c1-13-7-8-18-16(11-13)19(23)9-10-22(18)12-20(24)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,24)
InChIKeyQLXUJQDAJSMNMJ-UHFFFAOYSA-N
XLogP3.57
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide (CID 100741423) is N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide is Cc1ccc2c(c1)c(=O)ccn2CC(=O)Nc1cccc(C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide?
The InChIKey is QLXUJQDAJSMNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-13-7-8-18-16(11-13)19(23)9-10-22(18)12-20(24)21-17-6-4-5-14(2)15(17)3/h4-11H,12H2,1-3H3,(H,21,24).
What are the key properties of N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide?
N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide has a molecular weight of 320.39 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 100741423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).